Geometry & MOs

Info

ID:	347518
PubChem CID:	127272373
Reduced:	O3N4C21H34 (1)
Stoich.:	A3B4C21D34 (1)
Weight, g/mol:	397.272927
ΔH_f, kcal/mol:	-133.86
Dipole, Da:	8.18
IP(EA), eV:	-8.86(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-phenyl-2-pyrrolidin-1-ylethyl)-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)N2CCCC2)C(=O)N3CCN(CC3)CC(=O)NC4CC4

DOS

IR

Vibrations